Match Hartree energy
Commits >
Commit abc749737cc12a5b79d975879ed425be2e62065f >
Run spack_foss-2022a_serial_min >
Input 18-TiO2.01-gs.inp
Value | Reference | Precision | Status |
4.244572645000000e+01 | 4.244572722000000e+01 | 2.880000000000000e-06 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)